5,7,8-triphenyl-1H-pyrido[2,3-d]pyrimidin-8-ium-2,4-dione perchlorate

Systemtic Name: 5,7,8-triphenyl-1H-pyrido[2,3-d]pyrimidin-8-ium-2,4-dione perchlorate Openeye Name: 5,7,8-triphenyl-1H-pyrido[2,3-d]pyrimidin-8-ium-2,4-dione perchlorate CAS Name: 5,7,8-triphenyl-1H-pyrido[2,3-d]pyrimidin-8-ium-2,4-dione perchlorate IUPAC Name: 5,7,8-triphenyl-1H-pyrido[2,3-d]pyrimidin-8-ium-2,4-dione perchlorate Traditional Name: 5,7,8-triphenyl-1H-pyrido[2,3-d]pyrimidin-8-ium-2,4-quinone perchlorate Formula: C25H18ClN3O6 MolecularWeight: 491.87992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[N+](C3=C2C(=O)NC(=O)N3)C4=CC=CC=C4)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[N+](C3=C2C(=O)NC(=O)N3)C4=CC=CC=C4)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C25H17N3O2.ClHO4/c29-24-22-20(17-10-4-1-5-11-17)16-21(18-12-6-2-7-13-18)28(19-14-8-3-9-15-19)23(22)26-25(30)27-24;2-1(3,4)5/h1-16H,(H,27,29,30);(H,2,3,4,5)